Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 4/20 | 0.44 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.44 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.44 |
| ▸ | PTPRC | P08575 | 2/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | STK10 | O94804 | 2/20 | 0.35 |
| ▸ | SLK | Q9H2G2 | 2/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | TMIGD3 | P0DMS9 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | EDNRA | P25101 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28025979 | 0.79 | ALDH1A1 (0.41) | PTPRCKCNH2BCHECYP2C19KDM4E | |
| SCHEMBL28219800 | 0.74 | NAT1 (0.40) | PTPRCADORA2ABCHECYP3A4CYP2C19 | |
| SCHEMBL8849472 | 0.73 | PTPRC (0.61) | CYP2A6CYP2B6CYP2E1PTPRCMAOB | |
| SCHEMBL28025964 | 0.71 | ALDH1A1 (0.41) | MAOBADORA2AADORA1KDM4EMEN1 | |
| SCHEMBL4946960 | 0.71 | CYP2A6 (0.64) | CYP2A6CYP2B6CYP2E1PTPRCMAOB | |
| SCHEMBL6320052 | 0.71 | CYP2A6 (0.52) | CYP2A6CYP2B6CYP2E1PTPRCMAOB | |
| SCHEMBL28025428 | 0.70 | GSTP1 (0.47) | CYP2A6MAOBCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL142992 | 0.69 | PTPRC (0.51) | CYP2A6CYP2B6CYP2E1PTPRCMAOB | |
| SCHEMBL28025431 | 0.69 | CYP2A6 (0.45) | CYP2A6CYP2B6CYP2E1MAOBCYP3A4 | |
| SCHEMBL30165237 | 0.67 | CYP2A6 (0.52) | CYP2A6CYP2B6CYP2E1PTPRCMAOB |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108137729-B | Catalysts for forming multimodal polymers | 埃克森美孚化学专利公司 | 2021-02-05 | — | — | CN | disclosed |
| CN-104822697-A | Bridged metallocene compounds, catalyst systems and polymerization processes using the same | EXXONMOBIL CHEM PATENTS INC | 2015-08-05 | — | — | CN | disclosed |